SCHEMBL14324853

SCHEMBL14324853

OC[C@H]1OC(c2ccc(Cl)c(Cc3ccc(CCCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 20/20 0.78
SLC5A1 P13866 19/20 0.78
ADRA2A P08913 1/20 0.66
SLC5A11 Q8WWX8 1/20 0.66

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL500113 1.00 SLC5A2 (0.78) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL500041 0.94 SLC5A2 (0.81) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL10169639 0.88 SLC5A2 (0.78) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL499736 0.88 SLC5A2 (0.78) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL14855909 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL15324563 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL22264462 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL16421564 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL302200 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11
Bexagliflozin SCHEMBL16510222 0.88 SLC5A2 (1.00) SLC5A2SLC5A1ADRA2ASLC5A11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120329732-A1 BENZYLBENZENE DERIVATIVES AND METHODS OF USE THERACOS, INC. (US) 2012-12-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120329732-A1 BENZYLBENZENE DERIVATIVES AND METHODS OF USE SLC5A2, SLC5A1, SLC2A4 SLC5A2 1/4885SLC5A1 2/4885ADRA2A 1525/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.